AG00DDRJ

5157-08-4 | 4,5-DIHYDRO-6-METHYLPYRIDAZIN-3(2H)-ONE

AG00DDRJ

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CAS Number	5157-08-4
Catalog Number	AG00DDRJ(AGN-PC-0JLRMK)
Chemical Name	4,5-DIHYDRO-6-METHYLPYRIDAZIN-3(2H)-ONE
IUPAC Name	3-methyl-4,5-dihydro-1H-pyridazin-6-one
InChI	InChI=1S/C5H8N2O/c1-4-2-3-5(8)7-6-4/h2-3H2,1H3,(H,7,8)
InChI Key	VOTFXESXPPEARL-UHFFFAOYSA-N
MDL Number	MFCD00149420
Molecular Formula	C5H8N2O
Molecular Weight	112.1298
SMILES	O=C1CCC(C)=NN1
UNII	YQF2AB3MJY
Synonyms	5157-08-4, 6-methyl-4,5-dihydropyridazin-3(2H)-one, 4,5-Dihydro-6-methylpyridazin-3(2H)-one, 6-methyl-2,3,4,5-tetrahydropyridazin-3-one, 3(2H)-Pyridazinone, 4,5-dihydro-6-methyl-, 4,5-Dihydro-6-methyl-3(2H)-pyridazinone, UNII-YQF2AB3MJY, YQF2AB3MJY, NSC 14585, 3-methyl-4,5-dihydro-1H-pyridazin-6-one, MFCD00006455, NSC 48103, 6-methyl-4,5-dihydro-3(2H)-pyridazinone, WLN: T6NMV FUTJ F1, 6-methyl-2,4,5-trihydropyridazin-3-one, 3(2H)-Pyridazinone,5-dihydro-6-methyl-, 4,5-Dihydro-6-methylpyridazin-3(2H)-one monohydrate, AC1Q6FTR, ACMC-209w0x, KSC498C6J, SCHEMBL138271, AC1L2W27, AC1Q2Q46, CTK3J8164, DTXSID20199521, VOTFXESXPPEARL-UHFFFAOYSA-N, HMS1645L20, ZINC152911, ALBB-011783, EBD16223, KS-00003QP6, NSC14585, NSC48103, ANW-45775, BBL013890, NSC-14585, NSC-48103, SBB043888, STK359388, AKOS000274388, AKOS025243305, AC-8382, AN-3746, CD-1436, CS-W011268, MCULE-3548202908, PS-4152, RP00560, RTC-010777, VZ27571, WT82128, KS-00000K29, AJ-12842, AK-88553, CJ-01199, Q671, SY023987, 4,5-Dihydro-6-methyl-3(2H)pyridazinone, 6-methyl-4,5-dihydro-2H-pyridazin-3-one, AB1010282, DB-028656, LS-129903, ST2406513, TC-010777, 4CH-002624, BB 0259201, D4216, DIHYDRO-6-METHYLPYRIDAZIN-3(2H)-ONE, FT-0617184, ST45029678, EN300-41077, MFCD00006455 (95%), C-4813, 157D084, I14-1647, I14-6271, J-518882, W-204289, 6-Methyl-4,5-dihydro-3(2H)-pyridazinone monohydrate, Z49527484, F0918-7052, 2-Methylterephthalic acid, C5H8N2O, CID78834, AR-1H2216, MFCD00015450, ACN-037695, (2-chloro-5-fluorophenyl)methanesulfonyl chloride, 205744-83-8, 5394-11-6,

Complexity	139
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	112.064g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	112.132g/mol
Monoisotopic Mass	112.064g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	41.5A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	-0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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